IBD Research Resource Center

BioID	bio1165
Name	None
ChEMBL ID	CHEMBL480143
Molecular Formula	C11H15N5O4
Molecular Weight	281.27
Molecular Weight (Monoisotopic)	281.1124
Type	Small molecule
Max Phase	--
Target ID	Tar11
Target Name	Proto-oncogene c-RAF (c-RAF)
Synonyms	3'-C-Methyladenosine
Smiles	C[C@@]1(O)[C@@H](CO)O[C@@H](n2cnc3c(N)ncnc32)[C@@H]1O
Inchi	InChI=1S/C11H15N5O4/c1-11(19)5(2-17)20-10(7(11)18)16-4-15-6-8(12)13-3-14-9(6)16/h3-5,7,10,17-19H,2H2,1H3,(H2,12,13,14)/t5-,7+,10-,11-/m1/s1
Inchi Key	MLIWWOXSMXQECL-ZGUVBZSNSA-N
Molecular Species	NEUTRAL
Targets	19.0
Bioactivities	50.0
Np Likeness Score	1.41
Records Key	[3'-Me-Ado", '23', '29a', "3 (3'-Me-Ado)", "3''-Me-Ado", "3'-Me-Ado", "3'-Me-Ado", "3'-Me-Ado", "5, 3'-Me-Ado"]"
Records Name	['5-(6-Amino-purin-9-yl)-3-methyl-tetrahydro-furan-2,3,4-triol', '(2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-2-(hydroxymethyl)-3-methyloxolane-3,4-diol', '5-(6-Amino-purin-9-yl)-2-hydroxymethyl-3-methyl-tetrahydro-furan-3,4-diol', '(2R,4S,5R)-5-(6-Amino-purin-9-yl)-2-hydroxymethyl-3-methyl-tetrahydro-furan-3,4-diol', '5-(6-Amino-purin-9-yl)-2-hydroxymethyl-3-methyl-tetrahydro-furan-3,4-diol', '5-(6-Amino-purin-9-yl)-2-hydroxymethyl-3-methyl-tetrahydro-furan-3,4-diol', '(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-(hydroxymethyl)-3-methyl-tetrahydrofuran-3,4-diol', 3'-C-methyladenosine", "3'-C-methyladenosine"]"
Withdrawn Flag	False
Orphan	-1